Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1A' and Ligand = 'BDBM50532894'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50532894 (CHEMBL4483779) Show SMILES CCOc1ccccc1N1CCN(CCC(=O)N2CCN(CC2)c2cccc(Cl)c2)CC1 Show InChI InChI=1S/C25H33ClN4O2/c1-2-32-24-9-4-3-8-23(24)29-14-12-27(13-15-29)11-10-25(31)30-18-16-28(17-19-30)22-7-5-6-21(26)20-22/h3-9,20H,2,10-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Catania Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation spectrometry				Bioorg Med Chem Lett 26: 4052-6 (2016) Article DOI: 10.1016/j.bmcl.2016.06.080 BindingDB Entry DOI: 10.7270/Q2VM4GS6
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50532894 (CHEMBL4483779) Show SMILES CCOc1ccccc1N1CCN(CCC(=O)N2CCN(CC2)c2cccc(Cl)c2)CC1 Show InChI InChI=1S/C25H33ClN4O2/c1-2-32-24-9-4-3-8-23(24)29-14-12-27(13-15-29)11-10-25(31)30-18-16-28(17-19-30)22-7-5-6-21(26)20-22/h3-9,20H,2,10-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Catania Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation spectrometry				Bioorg Med Chem Lett 26: 4052-6 (2016) Article DOI: 10.1016/j.bmcl.2016.06.080 BindingDB Entry DOI: 10.7270/Q2VM4GS6
					More data for this Ligand-Target Pair